Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:05 UTC
Update Date2025-03-21 18:33:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00098278
Frequency28.0
Structure
Chemical FormulaC11H14O
Molecular Mass162.1045
SMILESc1ccc(CC2CCCO2)cc1
InChI KeyLBHBYZMERVVPBK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • oxacycle
  • monocyclic benzene moiety
  • ether
  • organic oxygen compound
  • aromatic heteromonocyclic compound
  • tetrahydrofuran
  • hydrocarbon derivative
  • dialkyl ether
  • organoheterocyclic compound
  • organooxygen compound